1,3-dimethyl-2-[(4-methylphenyl)-phenylmethoxy-methyl]benzimidazol-3-ium iodide

Systemtic Name: 1,3-dimethyl-2-[(4-methylphenyl)-phenylmethoxy-methyl]benzimidazol-3-ium iodide Openeye Name: 2-[benzyloxy(p-tolyl)methyl]-1,3-dimethyl-benzimidazol-3-ium iodide CAS Name: 1,3-dimethyl-2-[(4-methylphenyl)-phenylmethoxymethyl]benzimidazol-3-ium iodide IUPAC Name: 1,3-dimethyl-2-[(4-methylphenyl)-phenylmethoxymethyl]benzimidazol-3-ium iodide Traditional Name: 2-[benzoxy(p-tolyl)methyl]-1,3-dimethyl-benzimidazol-3-ium iodide Formula: C24H25IN2O MolecularWeight: 484.37257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=[N+](C3=CC=CC=C3N2C)C)OCC4=CC=CC=C4.[I-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=[N+](C3=CC=CC=C3N2C)C)OCC4=CC=CC=C4.[I-]

InChI

InChI=1S/C24H25N2O.HI/c1-18-13-15-20(16-14-18)23(27-17-19-9-5-4-6-10-19)24-25(2)21-11-7-8-12-22(21)26(24)3;/h4-16,23H,17H2,1-3H3;1H/q+1;/p-1